Geometry & MOs

Info

ID:	123827
PubChem CID:	50862820
Reduced:	SO2N3C23H31 (1)
Stoich.:	AB2C3D23E31 (1)
Weight, g/mol:	441.244999
ΔH_f, kcal/mol:	-75.94
Dipole, Da:	10.03
IP(EA), eV:	-8.26(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-diethyl-2-sulfanylidene-5-[(2,2,4,7-tetramethyl-1-propyl-3,4-dihydroquinolin-6-yl)methylidene]-1,3-diazinane-4,6-dione

Drug info:

PubChemData

Smile

CCCN1C2=C(C=C(C(=C2)C)C=C3C(=O)N(C(=S)N(C3=O)C)C)C(CC1(C)C)C

DOS

IR

Vibrations